Vitas-M small molecule compound

ethyl 3-{2-[(3,4-dimethoxyphenyl)carbonyl]-1,1-dioxido-4H-1,4-benzothiazin-4-yl}benzoate

Catalog ID
STL095470
SMILES CCOC(=O)c1cccc(c1)N1C=C(C(=O)c2ccc(c(c2)OC)OC)S(=O)(=O)c2c1cccc2

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We supply compounds in quantities from 1 mg up to 5 g for research and development purposes only.

We do not supply quantities above 5 g.

Structure and other identifiers

2D representation rendered from the SMILES, with core physicochemical data.
Formula C26H23NO7S MW 493.54 g/mol Purity >90% as per NMR
InChI
InChI=1S/C26H23NO7S/c1-4-34-26(29)18-8-7-9-19(14-18)27-16-24(35(30,31)23-11-6-5-10-20(23)27)25(28)17-12-13-21(32-2)22(15-17)33-3/h5-16H,4H2,1-3H3
InChIKey
FXJVERPFLQIGJT-UHFFFAOYSA-N
Synonyms
1114853-29-0
1114853290
CCOC(=O)C1=CC(=CC=C1)N2C=C(S(=O)(=O)C3=CC=CC=C32)C(=O)C4=CC(=C(C=C4)OC)OC
ethyl3(2((34dimethoxyphenyl)carbonyl)11dioxido4H14benzothiazin4yl)benzoate
ETHYL3(2(34DIMETHOXYBENZOYL)11DIOXIDO4H14BENZOTHIAZIN4YL)BENZOATE
ETHYL3(2(34DIMETHOXYBENZOYL)11DIOXIDO4HBENZO(B)(14)THIAZIN4YL)BENZOATE
ethyl3(2(34dimethoxybenzoyl)11dioxo1$l^(6)4benzothiazin4yl)benzoate
InChI=1SC26H23NO7Sc143426(29)1887919(1418)271624(35(3031)2311651020(23)27)25(28)17121321(322)22(1517)333h516H4H213H3
MFCD14953620
ZINC000032984486
ZINC32984486

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Available files

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